Alpha-cypermethrin

C22H19Cl2NO3CAS 65731-84-2416.30 g/mol

OONOClCl
AlkeneEsterEtherNitrileVinyl halide

Properties

Molecular formula
C22H19Cl2NO3
Molar mass
416.30 g/mol
Exact mass
415.0742 Da
Density
1.28 g/mL (at 20 °C)
Melting point
53–55 °C
Water solubility
10 µg/L
logP
6.18Crippen estimate
Polar surface area
59.3 Ų
H-bond donors / acceptors
0 / 4
Rotatable bonds
6
Stereocentres
R, S, Rin SMILES atom order

Hazards

Danger
Acute Toxic (GHS06)Health Hazard (GHS08)Environmental Hazard (GHS09)

Harmonised EU classification (CLP Annex VI, index 607-422-00-X), via PubChem.

Precautionary statements

P260, P261, P264, P270, P271, P273, P301+P316, P304+P340, P319, P321, P330, P391, P403+P233, P405, P501

Identifiers

CAS number
65731-84-2
SMILES
CC1(C)[C@H](C(=O)O[C@H](C#N)c2cccc(Oc3ccccc3)c2)[C@@H]1C=C(Cl)Cl
InChIKey
KAATUXNTWXVJKI-NSHGMRRFSA-N
InChI
InChI=1S/C22H19Cl2NO3/c1-22(2)17(12-19(23)24)20(22)21(26)28-18(13-25)14-7-6-10-16(11-14)27-15-8-4-3-5-9-15/h3-12,17-18,20H,1-2H3/t17-,18+,20-/m0/s1

Weigh it out

Type any one amount. The others follow from the molar mass and density.

Names and synonyms

6 names
  • (S)-Cyano(3-phenoxyphenyl)methyl (1R,3R)-3-(2,2-dichloroethenyl)-2,2-dimethylcyclopropanecarboxylate
  • Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, (S)-cyano(3-phenoxyphenyl)methyl ester, (1R,3R)-
  • Cyclopropanecarboxylic acid, 3-(2,2-dichloroethenyl)-2,2-dimethyl-, cyano(3-phenoxyphenyl)methyl ester, [1R-[1α(S*),3α]]-
  • NRDC 168S
  • RU 24501
  • WL 48281

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Stereoisomers, salts and isotopologues

The same compound in another form: other stereochemistry, a salt or hydrate, the free acid or base, or an isotope-labelled version.

Similar compounds

Tanimoto similarity of circular fingerprints over the whole catalogue.

Elsewhere